MaterialsAtlas Tutorial

MACE Tutorials

maceequivariantmliptutorialscomputational-materialsmaterials-education

MACE tutorials for training equivariant machine-learning interatomic potentials and running atomistic inference or molecular dynamics.

Citation: MACE Tutorials. Materials tutorial resource. https://mace-docs.readthedocs.io/

Acknowledgement: Curated by MaterialsAtlas Open Resources from official documentation, tutorial collections, notebooks, workshop materials, and educational resources.

TypeTutorial
DomainGraph deep learning / MLIPs
LicenseTutorial / documentation; see source
Contributorsmace-docs.readthedocs.io